IFLAB-ZINC05147119 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0660 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2560 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -5.0460 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -6.3640 -0.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -7.6310 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -8.6680 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -7.9850 1.2300 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.3040 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -5.0530 1.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -7.8310 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -7.7960 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -7.6250 -2.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -7.9550 -4.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -7.9210 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -8.1210 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -9.3010 -7.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -9.2380 -8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -8.0070 -9.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -6.8350 -7.7060 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6210 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5980 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1390 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.7120 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -9.7130 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -7.0370 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -8.7960 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -8.0920 -5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -8.7150 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -6.9560 -4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -10.2350 -6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -10.1190 -9.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -7.7670 -10.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 M END